Geometry & MOs

Info

ID:	385023
PubChem CID:	134978165
Reduced:	NO2C27H33 (1)
Stoich.:	AB2C27D33 (1)
Weight, g/mol:	417.266779
ΔH_f, kcal/mol:	-16.58
Dipole, Da:	4.68
IP(EA), eV:	-8.42(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)C1=NC(C(C1=C=C(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)(C)C)(C)C

DOS

IR

Vibrations